ethyl 2-{[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
ethyl 2-{[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C098-0621 |
| Compound Name: | ethyl 2-{[3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl]imino}-1-[(furan-2-yl)methyl]-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 601.98 |
| Molecular Formula: | C30 H21 Cl F N5 O6 |
| Smiles: | CCOC(C1=CC2=C(N=C3C=CC=CN3C2=O)N(Cc2ccco2)C/1=N/C(c1c(c2c(cccc2[Cl])F)noc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6584 |
| logD: | 3.6571 |
| logSw: | -4.489 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 99.403 |
| InChI Key: | CCGMUPZCMVWXFA-UHFFFAOYSA-N |